SCHEMBL20165422

SCHEMBL20165422

CCCCN(C(=O)OCC)C(CC(=O)OCC)CC(C)C

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
HSD17B10 Q99714 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
CYP1A2 P05177 1/20 0.30
TRPA1 O75762 1/20 0.30
CYP3A4 P08684 1/20 0.30
ALOX15 P16050 1/20 0.30
TSHR P16473 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL21522947 0.91 ALDH1A1 (0.35) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL28488314 0.89 ALDH1A1 (0.40) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL20168883 0.85 ALDH1A1 (0.38) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL20166073 0.85 ALDH1A1 (0.38) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL21522917 0.85 MGAM (0.35) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL20180243 0.84 ALDH1A1 (0.38) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL21522880 0.84 MGAM (0.34) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL20168886 0.82 ALDH1A1 (0.37) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL28485049 0.79 ALDH1A1 (0.38) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL20180242 0.78 ALDH1A1 (0.35) ALDH1A1LMNAPOLBHSD17B10L3MBTL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3541857-B1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA SRL (IT) 2020-09-09 EP disclosed
US-10654946-B2 Catalyst components for the polymerization of olefins BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2020-05-19 US disclosed
US-20190330388-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2019-10-31 US disclosed
EP-3541857-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.r.l. (IT) 2019-09-25 EP disclosed
WO-2018091375-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2018-05-24 WO disclosed